3,4-dichloro-N-(3-methoxyphenyl)benzamide

C14H11Cl2NO2 — CID 835122

IUPAC3,4-dichloro-N-(3-methoxyphenyl)benzamide
SMILESCOc1cccc(NC(=O)c2ccc(Cl)c(Cl)c2)c1
InChIInChI=1S/C14H11Cl2NO2/c1-19-11-4-2-3-10(8-11)17-14(18)9-5-6-12(15)13(16)7-9/h2-8H,1H3,(H,17,18)
InChIKeyKJPPLOIKMJLXFG-UHFFFAOYSA-N
MW296.15 g/mol
LogP4.25
Rot. Bonds3

About 3,4-dichloro-N-(3-methoxyphenyl)benzamide

3,4-dichloro-N-(3-methoxyphenyl)benzamide (PubChem CID 835122) has the molecular formula C14H11Cl2NO2 and a molecular weight of 296.15 g/mol. Its IUPAC name is 3,4-dichloro-N-(3-methoxyphenyl)benzamide.

Molecular Properties

Compound Name3,4-dichloro-N-(3-methoxyphenyl)benzamide
PubChem CID835122
Molecular FormulaC14H11Cl2NO2
Molecular Weight296.15 g/mol
Exact Mass295.02
IUPAC Name3,4-dichloro-N-(3-methoxyphenyl)benzamide
SMILESCOc1cccc(NC(=O)c2ccc(Cl)c(Cl)c2)c1
InChIInChI=1S/C14H11Cl2NO2/c1-19-11-4-2-3-10(8-11)17-14(18)9-5-6-12(15)13(16)7-9/h2-8H,1H3,(H,17,18)
InChIKeyKJPPLOIKMJLXFG-UHFFFAOYSA-N
XLogP4.25
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.15
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,4-dichloro-N-(3-methoxyphenyl)benzamide?
The IUPAC name of 3,4-dichloro-N-(3-methoxyphenyl)benzamide (CID 835122) is 3,4-dichloro-N-(3-methoxyphenyl)benzamide.
What is the SMILES notation for 3,4-dichloro-N-(3-methoxyphenyl)benzamide?
The canonical SMILES for 3,4-dichloro-N-(3-methoxyphenyl)benzamide is COc1cccc(NC(=O)c2ccc(Cl)c(Cl)c2)c1.
What is the InChIKey of 3,4-dichloro-N-(3-methoxyphenyl)benzamide?
The InChIKey is KJPPLOIKMJLXFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Cl2NO2/c1-19-11-4-2-3-10(8-11)17-14(18)9-5-6-12(15)13(16)7-9/h2-8H,1H3,(H,17,18).
What are the key properties of 3,4-dichloro-N-(3-methoxyphenyl)benzamide?
3,4-dichloro-N-(3-methoxyphenyl)benzamide has a molecular weight of 296.15 g/mol, XLogP of 4.25, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dichloro-N-(3-methoxyphenyl)benzamide is sourced from PubChem (CID 835122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).